PUBCHEM-ZINC05929457 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 0.4510 1.5900 -0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 0.0610 -0.4480 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5630 -0.2930 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -0.5020 -1.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 -1.9620 -1.7750 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7700 -2.7880 -1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -4.0640 -1.5560 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8510 -4.8640 -1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -4.0140 -1.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 -2.6520 -2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 -2.3120 -2.4280 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4630 -3.2430 -2.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 -4.5380 -2.5390 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 -4.9620 -2.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7190 -6.3170 -2.0720 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 -7.2560 -2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -6.9950 -3.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4840 -7.9250 -3.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -9.1140 -3.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7550 -9.3770 -2.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 -8.4540 -1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7400 -2.8520 -3.0270 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 -0.3780 0.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -0.5220 1.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -2.0330 1.8680 P 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -3.2100 1.6090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 1.9430 -0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 1.9240 -1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 1.9900 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 -0.0960 -2.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 -0.2220 -1.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7720 -2.4950 -1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -6.6130 -1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4450 -6.0660 -4.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1430 -7.7230 -4.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3420 -9.8400 -3.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8450 -10.3070 -1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -8.6620 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 -1.9090 -3.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4220 -3.5200 -3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -0.5950 2.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 0.3440 2.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 -2.1960 3.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 -1.9260 0.7190 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 -1.1760 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 -2.9800 3.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 23 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 43 46 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 5 1 M END